Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP2A6 | P11509 | 1/20 | 0.40 |
| ▸ | TP53 | P04637 | 7/20 | 0.39 |
| ▸ | SMN1; SMN2 | Q16637 | 7/20 | 0.39 |
| ▸ | PKM | P14618 | 7/20 | 0.39 |
| ▸ | RAB9A | P51151 | 7/20 | 0.39 |
| ▸ | NPC1 | O15118 | 6/20 | 0.39 |
| ▸ | KDM4E | B2RXH2 | 8/20 | 0.38 |
| ▸ | LMNA | P02545 | 5/20 | 0.38 |
| ▸ | CCR1 | P32246 | 3/20 | 0.38 |
| ▸ | CCR5 | P51681 | 3/20 | 0.38 |
| ▸ | CCR8 | P51685 | 3/20 | 0.38 |
| ▸ | POLB | P06746 | 2/20 | 0.38 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.38 |
| ▸ | METAP1 | P53582 | 1/20 | 0.38 |
| ▸ | BLM | P54132 | 1/20 | 0.38 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.38 |
| ▸ | DOHH | Q9BU89 | 1/20 | 0.38 |
| ▸ | P4HTM | Q9NXG6 | 1/20 | 0.38 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.38 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.38 |
Click a target to see other patent compounds predicted against it — the reverse direction, in place.
Similar compounds — the chemically nearest patent molecules
Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.
| Compound | similarity | top predicted | shared targets | |
|---|---|---|---|---|
| SCHEMBL21295834 | 0.76 | KDM4E (0.38) | CYP2A6TP53SMN1; SMN2PKMRAB9A | |
| SCHEMBL28570256 | 0.74 | DYRK1A (0.53) | SMN1; SMN2RAB9ANPC1KDM4ELMNA | |
| SCHEMBL28588283 | 0.74 | CYP2A6 (0.47) | CYP2A6RAB9ANPC1KDM4ECYP1A2 | |
| SCHEMBL21296084 | 0.73 | DYRK1A (0.56) | CYP2A6TP53SMN1; SMN2PKMRAB9A | |
| SCHEMBL21295720 | 0.70 | KDM4E (0.38) | TP53SMN1; SMN2PKMRAB9ANPC1 | |
| SCHEMBL21295876 | 0.70 | KDM4E (0.38) | TP53SMN1; SMN2PKMRAB9ANPC1 | |
| SCHEMBL21295979 | 0.70 | KDM4E (0.38) | CYP2A6TP53SMN1; SMN2RAB9ANPC1 | |
| SCHEMBL21295946 | 0.70 | KDM4E (0.50) | CYP2A6TP53SMN1; SMN2PKMRAB9A | |
| SCHEMBL9958218 | 0.69 | KDM4E (0.54) | CYP2A6TP53SMN1; SMN2PKMRAB9A | |
| SCHEMBL21296112 | 0.69 | KDM4E (0.41) | CYP2A6TP53SMN1; SMN2PKMRAB9A |
Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.
Patent provenance — the patents this molecule appears in, and who filed them
Claimed or disclosed in 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-109311844-B | Triazine compound, method for producing same, and organic electroluminescent element containing same as constituent component | 东曹株式会社 | 2021-07-20 | — | — | CN | disclosed |
| CN-112912372-A | Cyclic azine compound, material for organic electroluminescent element, electron transport material for organic electroluminescent element, and organic electroluminescent element | 东曹株式会社 | 2021-06-04 | — | — | CN | disclosed |